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Filtered by domain: molecular-property-predictionClear

Scalable Message-Passing Quantum Graph Neural Networks in the Weisfeiler-Leman Hierarchy

25 Jun 2026

Graphs provide a natural language for relational data in chemistry, biology and optimisation. Graph neural networks (GNNs) have driven much of the recent progress in learning from such data through message passing, a single primitive that generalises convolution and attention.

Graph Machine Learning Molecular Property Prediction

10.0/h

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